SCHEMBL25899012

SCHEMBL25899012

Cc1cnc(N)c2c1cnn2C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PI4KA P42356 2/20 0.46
▸ PI4K2B Q8TCG2 2/20 0.46
▸ PI4K2A Q9BTU6 2/20 0.46
▸ PI4KB Q9UBF8 2/20 0.46
▸ NOS3 P29474 2/20 0.36
▸ NOS1 P29475 2/20 0.36
▸ NOS2 P35228 2/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ XDH P47989 1/20 0.35
▸ TP53 P04637 2/20 0.33
▸ AHCY P23526 1/20 0.31
▸ KDM4E B2RXH2 3/20 0.30
▸ HPGD P15428 2/20 0.30
▸ MAPK1 P28482 2/20 0.30
▸ HSD17B10 Q99714 2/20 0.30
▸ LMNA P02545 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ USP2 O75604 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ HAVCR2 Q8TDQ0 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL25320775 0.79 PI4KA (0.44) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL25899217 0.78 PI4KA (0.43) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL25899266 0.77 PI4KA (0.42) PI4KAPI4K2BPI4K2API4KBNOS3
SCHEMBL30886293 0.74 PI4KA (0.52) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL25919989 0.74 PI4KA (0.40) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL25320978 0.72 PI4KA (0.49) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL25322907 0.72 PI4KA (0.38) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL13486140 0.71 HPGD (0.37) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL21608555 0.69 PI4KA (0.38) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL31318903 0.67 PI4KA (0.44) PI4KAPI4K2BPI4K2API4KBALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023146990-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. (US) 2023-08-03 — — WO disclosed
WO-2023146991-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. (US) 2023-08-03 — — WO disclosed
WO-2023146987-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. (US) 2023-08-03 — — WO disclosed
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